Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a6c8fc2c5dbf359e8de3b817986fece9",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.536,
"b": 95.536,
"c": 45.872,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.540,1.170],
"number_observations": 589758,
"number_observations_unique": 59229,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 85.000
},
{
"type": "Redundancy",
"value": 10.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.190,1.170],
"number_observations": 1054,
"number_observations_unique": 884,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.977
},
{
"type": "R(meas)",
"value": 1.364
},
{
"type": "R(pim)",
"value": 0.950
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 25.900
},
{
"type": "Redundancy",
"value": 1.200
},
{
"type": "CC(1/2)",
"value": 0.400
}
]
},
{
"resolution_limits": [67.540,6.410],
"number_observations": 5849,
"number_observations_unique": 459,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 46.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.700
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}